Full name : Derat Etienne
First name : Etienne
Mail : Institut Parisien de Chimie Moleculaire Sorbonne Universite, 4 Place Jussieu, 75252 Paris cedex 5
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Country : France
Email : etienne.derat@sorbonne-universite.fr
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Comment
| Title : Halogenated monopyridinium oximes are less effective in reactivation of phosphylated cholinesterases than bisquaternary oximes - Kohoutova_2024_Bioorg.Chem_153_107904 |
| Author(s) : Kohoutova Z , Prchalova E , Andrys R , Knittelova K , Formanova M , Hofmanova T , Psotka M , Musilek K , Derat E , Malinak D |
| Ref : Bioorg Chem , 153 :107904 , 2024 |
| Abstract : |
| PubMedSearch : Kohoutova_2024_Bioorg.Chem_153_107904 |
| PubMedID: 39467508 |
| Title : Unveiling the Full Dynamical and Reactivity Profiles of Acetylcholinesterase: A Comprehensive All-Atom Investigation}, - Celerse_2024_ACS.Catal_14_1785 |
| Author(s) : Celerse F , Lagardre L , Bouchibti Y , Nachon F , Verdier L , Piquemal JP , Derat E |
| Ref : ACS Catal , 14 :1785 , 2024 |
| Abstract : |
| PubMedSearch : Celerse_2024_ACS.Catal_14_1785 |
| PubMedID: |
| Title : Computational Advances in Protein Engineering and Enzyme Design - |
| Author(s) : Derat E , Kamerlin SCL |
| Ref : J Phys Chem B , 126 :2449 , 2022 |
| PubMedID: 35387452 |
| Title : Phenyl Silicates with Substituted Catecholate Ligands: Synthesis, Structural Studies and Reactivity - Levernier_2021_Chemistry_27_8782 |
| Author(s) : Levernier E , Jaouadi K , Zhang HR , Corce V , Bernard A , Gontard G , Troufflard C , Grimaud L , Derat E , Ollivier C , Fensterbank L |
| Ref : Chemistry , 27 :8782 , 2021 |
| Abstract : |
| PubMedSearch : Levernier_2021_Chemistry_27_8782 |
| PubMedID: 33856711 |
| Title : On the Influence of the Protonation States of Active Site Residues on AChE Reactivation: A QM\/MM Approach - Driant_2017_Chembiochem_18_666 |
| Author(s) : Driant T , Nachon F , Ollivier C , Renard PY , Derat E |
| Ref : Chembiochem , 18 :666 , 2017 |
| Abstract : |
| PubMedSearch : Driant_2017_Chembiochem_18_666 |
| PubMedID: 28106328 |
| Title : How valence bond theory can help you understand your (bio)chemical reaction - Shurki_2015_Chem.Soc.Rev_44_1037 |
| Author(s) : Shurki A , Derat E , Barrozo A , Kamerlin SC |
| Ref : Chem Soc Rev , 44 :1037 , 2015 |
| Abstract : |
| PubMedSearch : Shurki_2015_Chem.Soc.Rev_44_1037 |
| PubMedID: 25352378 |
| Title : Fixation of the two Tabun isomers in acetylcholinesterase: a QM\/MM study - Kwasnieski_2009_J.Phys.Chem.B_113_10001 |
| Author(s) : Kwasnieski O , Verdier L , Malacria M , Derat E |
| Ref : J Phys Chem B , 113 :10001 , 2009 |
| Abstract : |
| PubMedSearch : Kwasnieski_2009_J.Phys.Chem.B_113_10001 |
| PubMedID: 19569635 |